smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
C[C@H](N)C(=O)NCCNC(=O)c1ccc2c(c1)C(=O)c1cc(C(=O)NCCNC(=O)[C@H](C)[NH3+])ccc1C2=O	ZINC000040872350	562081555	/nfs/dbraw/zinc/08/15/55/562081555.db2.gz	DLNUBDODGHPUFZ-KBPBESRZSA-N	1	3	522.562	-1.152	1	10		KACFHO
C[C@H](N)C(=O)NCCNC(=O)c1ccc2c(c1)C(=O)c1ccc(C(=O)NCCNC(=O)[C@H](C)[NH3+])cc1C2=O	ZINC000040873069	562081714	/nfs/dbraw/zinc/08/17/14/562081714.db2.gz	RGCSODPZDDDMAC-KBPBESRZSA-N	1	3	522.562	-1.152	1	10		KACFHO
NC[C@@H](N)C(=O)NCC(=O)Nc1ccc2c(c1)C(=O)c1ccc(NC(=O)CNC(=O)[C@H](N)C[NH3+])cc1C2=O	ZINC000653721992	562908823	/nfs/dbraw/zinc/90/88/23/562908823.db2.gz	BSDHDQQLZAZTDH-QZTJIDSGSA-N	1	3	524.538	-2.857	1	10		KACFHO
NC[C@H](N)C(=O)NCC(=O)Nc1ccc2c(c1)C(=O)c1ccc(NC(=O)CNC(=O)[C@@H](N)C[NH3+])cc1C2=O	ZINC000653721993	562908820	/nfs/dbraw/zinc/90/88/20/562908820.db2.gz	BSDHDQQLZAZTDH-ROUUACIJSA-N	1	3	524.538	-2.857	1	10		KACFHO
C[C@H](NC(=O)[C@@H](N)CN)C(=O)Nc1ccc2c(c1)C(=O)c1ccc(NC(=O)[C@H](C)NC(=O)[C@@H](N)C[NH3+])cc1C2=O	ZINC000653737442	562909760	/nfs/dbraw/zinc/90/97/60/562909760.db2.gz	YDOXCKTXGLKUIZ-HIGYNYDNSA-N	1	3	552.592	-2.080	1	10		KACFHO
C[C@H](NC(=O)[C@H](N)CN)C(=O)Nc1ccc2c(c1)C(=O)c1ccc(NC(=O)[C@H](C)NC(=O)[C@H](N)C[NH3+])cc1C2=O	ZINC000653737444	562909794	/nfs/dbraw/zinc/90/97/94/562909794.db2.gz	YDOXCKTXGLKUIZ-SEEPXDQQSA-N	1	3	552.592	-2.080	1	10		KACFHO